2,6-Dibromo-3,4,5-trimethoxybenzoic acid
TL;DR: 2,6-Dibromo-3,4,5-trimethoxybenzoic acid (CAS 6307-91-1) is a chemical compound with molecular formula C10H10Br2O5 and molecular weight 367.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dibromo-3,4,5-trimethoxybenzoic acid
Also Known As: 2,6-dibromo-3,4,5-trimethoxybenzoic acid, 2,6-dibromo-3,4,5-trimethoxybenzoicacid, Benzoic acid,2,6-dibromo-3,4,5-trimethoxy-, 2,6-DIBROMO-3,4,5-TRIMETHOXY-BENZOIC ACID, AS-871/43475949
| Molecular Formula | C10H10Br2O5 |
|---|---|
| Molecular Weight | 367.89 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.8895 |
| Heavy Atoms | 17 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 6307-91-1 |
|---|---|
| SMILES | COC1=C(C(=C(C(=C1OC)Br)C(=O)O)Br)OC |
| InChIKey | KFEXAABXBSOKEH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Dibromo-3,4,5-trimethoxybenzoic acid (CAS 6307-91-1), with molecular formula C10H10Br2O5 and molecular weight 367.89 g/mol. IUPAC: 2,6-dibromo-3,4,5-trimethoxybenzoic acid.
Chemical Property Profile of 2,6-Dibromo-3,4,5-trimethoxybenzoic acid
Property Insights of 2,6-Dibromo-3,4,5-trimethoxybenzoic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dibromo-3,4,5-trimethoxybenzoic acid. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Dibromo-3,4,5-trimethoxybenzoic acid. Following Lipinski's Rule of Five, 2,6-Dibromo-3,4,5-trimethoxybenzoic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-Dibromo-3,4,5-trimethoxybenzoic acid?
The CAS number of 2,6-Dibromo-3,4,5-trimethoxybenzoic acid is 6307-91-1.
What is the molecular formula of 2,6-Dibromo-3,4,5-trimethoxybenzoic acid?
The molecular formula of 2,6-Dibromo-3,4,5-trimethoxybenzoic acid is C10H10Br2O5.
What is the molecular weight of 2,6-Dibromo-3,4,5-trimethoxybenzoic acid?
The molecular weight of 2,6-Dibromo-3,4,5-trimethoxybenzoic acid is 367.89 g/mol.
Where can I buy 2,6-Dibromo-3,4,5-trimethoxybenzoic acid?
You can request a quote for 2,6-Dibromo-3,4,5-trimethoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dibromo-3,4,5-trimethoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dibromo-3,4,5-trimethoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.